[email protected]
CAS 89405-44-7 4,5-BIS(2-CHLOROPHENYL)-1,3-THIAZOL-2-AMINE molecular structure lightbox
CAS RN: 89405-44-7

4,5-BIS(2-CHLOROPHENYL)-1,3-THIAZOL-2-AMINE

  • Product code: SSC-201376
GET A QUOTE
Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
Request Bulk Quote

Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 89405-44-7
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shanghai Inquiry

89405-44-7 / 4,5-bis(2-chlorophenyl)-1,3-thiazol-2-amine

Standard CAS: 89405-44-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
89405-44-7
Multi CAS
No
Molecular Formula
C15H10CL2N2S
Molecular Weight
321.200000
Exact Mass
319.994175
InChI
InChI=1S/C15H10Cl2N2S/c16-11-7-3-1-5-9(11)13-14(20-15(18)19-13)10-6-2-4-8-12(10)17/h1-8H,(H2,18,19)
InChIKey
OKEZTKMCIMHKKO-UHFFFAOYSA-N

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
17
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
87.42
TPSA
38.91

LogP / Solubility

WLOGP
5.37
MLOGP
4.74
XLogP3
5.2
Consensus LogP
5.1
Log S (ESOL)
-5.71
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.07
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-6.44
Class (SILICOS-IT)
Insoluble

ADME

GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.87

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5

Customers Also Viewed

Get In Touch

Contact Us